Related papers: Dissociative Recombination of CF$^+$
A new method that accurately describes strongly correlated states and captures dynamical correlation is presented. It is derived as a modification of coupled-cluster theory with single and double excitations (CCSD) through consideration of…
We present a study of dissociative electron attachment and vibrational excitation processes in electron collisions with the CF$_3$Cl molecule. The calculations are based on the two-dimensional nuclear dynamics including the C-Cl symmetric…
Detecting the internal state of polar molecules is a substantial challenge when standard techniques such as resonance-enhanced multi photon ionization (REMPI) or laser-induced fluorescense (LIF) do not work. As this is the case for most…
We proposed a distributed approximating functional method for efficiently describing the electronic dynamics in atoms and molecules in the presence of the Coulomb singularities, using the kernel of a grid representation derived by using the…
Strongly correlated systems containing d/f-electrons present a challenge to conventional density functional theory (DFT), such as the widely used local density approximation (LDA) or generalized gradient approximation (GGA). In this work,…
A statistical theory of resonant multielectron recombination based on properties of chaotic eigenstates is developed. The level density of many-body states increases exponentially with the number of excited electrons. When the residual…
High partial-wave ($l\ge2$) Feshbach resonance (FR) in an ultracold mixture of $^{85}$Rb-$^{87}$Rb atoms is investigated experimentally aided by a partial-wave insensitive analytic multichannel quantum-defect theory (MQDT). Two "broad"…
Radiative decays $D^*_{(s)}\to D_{(s)}\gamma$ are revisited in light of new experimental data from the \textit{BABAR} and BESIII collaborations. The radiative couplings $g_{D^*D\gamma}$ encoding nonperturbative QCD effects are calculated in…
This study presents calculations of rate coefficients, resonance strengths, and cross sections for the dielectronic recombination (DR) of $\text{Y}^{+}$, $\text{Sr}^{+}$, $\text{Te}^{2+}$, and $\text{Ce}^{2+}$-low-charge ions relevant to…
We investigated the bound state problem of the S wave charged $D_1 \bar{D}^*$ ($D_1' \bar{D}^*$) system in a chiral quark model by solving the resonating group method equation. Our preliminary study does not favor the molecular assumption…
Reduced density-matrix functional theory (RDMFT) provides a variational route to electronic correlations beyond conventional density-functional approximations, but explicit evaluations of density-matrix functionals still scale exponentially…
Exact diagonalization (ED) of small model systems gives the thermodynamics of spin chains or quantum cell models at high temperature $T$. Density matrix renormalization group (DMRG) calculations of progressively larger systems are used to…
Based on an approach recently proposed by us, simultaneous $\chi^{2}$-analyses are performed for elastic scattering, direct reaction (DR) and fusion cross sections data for the $^{6}$He+$^{209}$Bi system at near-Coulomb-barrier energies to…
The observation of fraction quantum Hall states in twisted MoTe2 has sparked a lof of interest in this phenomenon. Most theoretical works to date rely on the brute-force exact diagonalization which is limited to the one partially occupied…
We present a formalism for cold and ultracold atom-diatom chemical reactions that combines a quantum close-coupling method at short-range with quantum defect theory at long-range. The method yields full state-to-state rovibrationally…
A first attempt to accommodate the chiral and deconfining phase transitions of QCD in the bottom-up holographic framework is given. We constrain the relation between dilaton field $\phi$ and metric warp factor $A_e$ and get several…
Diffraction radiation (DR) is produced when a charged particle passes through an aperture or near a discontinuity in the media in which it is traveling. DR is closely related to transition radiation (TR), which is produced when a charged…
Electronic properties of quasi-two-dimensional molecular conductors $X$[Pd(dmit)$_2$]$_2$ are studied theoretically. We construct an effective model based on the fragment molecular orbital scheme developed recently, which can describe the…
We report the detection of linear and cyclic isomers of C3H and C3H2 towards various starless cores and review the corresponding chemical pathways involving neutral (C3Hx with x=1,2) and ionic (C3Hx+ with x = 1,2,3) isomers. We highlight…
A critical challenge for density functional theory (DFT) in practice is its limited ability to treat static electron correlation, leading to errors in its prediction of charges, multiradicals, and reaction barriers. Recently, we combined…